N-(furan-3-ylmethyl)-2-methylbenzamide

C13H13NO2 — CID 47285303

IUPACN-(furan-3-ylmethyl)-2-methylbenzamide
SMILESCc1ccccc1C(=O)NCc1ccoc1
InChIInChI=1S/C13H13NO2/c1-10-4-2-3-5-12(10)13(15)14-8-11-6-7-16-9-11/h2-7,9H,8H2,1H3,(H,14,15)
InChIKeyWRWNCKWGXRBBKN-UHFFFAOYSA-N
MW215.25 g/mol
LogP2.52
Rot. Bonds3

About N-(furan-3-ylmethyl)-2-methylbenzamide

N-(furan-3-ylmethyl)-2-methylbenzamide (PubChem CID 47285303) has the molecular formula C13H13NO2 and a molecular weight of 215.25 g/mol. Its IUPAC name is N-(furan-3-ylmethyl)-2-methylbenzamide.

Molecular Properties

Compound NameN-(furan-3-ylmethyl)-2-methylbenzamide
PubChem CID47285303
Molecular FormulaC13H13NO2
Molecular Weight215.25 g/mol
Exact Mass215.09
IUPAC NameN-(furan-3-ylmethyl)-2-methylbenzamide
SMILESCc1ccccc1C(=O)NCc1ccoc1
InChIInChI=1S/C13H13NO2/c1-10-4-2-3-5-12(10)13(15)14-8-11-6-7-16-9-11/h2-7,9H,8H2,1H3,(H,14,15)
InChIKeyWRWNCKWGXRBBKN-UHFFFAOYSA-N
XLogP2.52
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(furan-3-ylmethyl)-3-hydroxy-2-methylbenzamide
CID 113342680
N-[(4-aminophenyl)methyl]-2-methylbenzamide
CID 60892796
N-(furan-3-ylmethyl)-1H-indole-7-carboxamide
CID 115659835
N-[[3-(bromomethyl)phenyl]methyl]-2-methylbenzamide
CID 114312955
N-(hydroxymethyl)-2-methylbenzamide
CID 5234338
2-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 3580913
2-methyl-N-(1H-pyrazol-4-ylmethyl)benzamide
CID 60736201
5-bromo-N-(furan-3-ylmethyl)-4-methylthiophene-2-carboxamide
CID 115683147
N-(furan-3-ylmethyl)-4-hydroxybenzamide
CID 115870248
2-methyl-N-[(1-methylpyrrol-2-yl)methyl]benzamide
CID 110472049
2-methyl-N-[(4-propan-2-yloxyphenyl)methyl]benzamide
CID 46592887
5-chloro-N-(furan-3-ylmethyl)-2-hydroxybenzamide
CID 47204985

Frequently Asked Questions

What is the IUPAC name of N-(furan-3-ylmethyl)-2-methylbenzamide?
The IUPAC name of N-(furan-3-ylmethyl)-2-methylbenzamide (CID 47285303) is N-(furan-3-ylmethyl)-2-methylbenzamide.
What is the SMILES notation for N-(furan-3-ylmethyl)-2-methylbenzamide?
The canonical SMILES for N-(furan-3-ylmethyl)-2-methylbenzamide is Cc1ccccc1C(=O)NCc1ccoc1.
What is the InChIKey of N-(furan-3-ylmethyl)-2-methylbenzamide?
The InChIKey is WRWNCKWGXRBBKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO2/c1-10-4-2-3-5-12(10)13(15)14-8-11-6-7-16-9-11/h2-7,9H,8H2,1H3,(H,14,15).
What are the key properties of N-(furan-3-ylmethyl)-2-methylbenzamide?
N-(furan-3-ylmethyl)-2-methylbenzamide has a molecular weight of 215.25 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-3-ylmethyl)-2-methylbenzamide is sourced from PubChem (CID 47285303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).